1-[4-[[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]ethanone

Systemtic Name: 1-[4-[[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]ethanone Openeye Name: 1-[4-[[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]amino]phenyl]ethanone CAS Name: 1-[4-[[5-amino-6-(N-ethyl-3-methylanilino)-4-pyrimidinyl]amino]phenyl]ethanone IUPAC Name: 1-[4-[[5-amino-6-(N-ethyl-3-methylanilino)pyrimidin-4-yl]amino]phenyl]ethanone Traditional Name: 1-[4-[[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]amino]phenyl]ethanone Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H23N5O/c1-4-26(18-7-5-6-14(2)12-18)21-19(22)20(23-13-24-21)25-17-10-8-16(9-11-17)15(3)27/h5-13H,4,22H2,1-3H3,(H,23,24,25)